| CAS Number | 1609396-38-4 |
| Catalog Number | AG00J3L6 |
| Chemical Name | [2-(4-chlorophenyl)ethyl](2-nitrobenzyl)amine hydrobromide |
| IUPAC Name | 2-(4-chlorophenyl)-N-[(2-nitrophenyl)methyl]ethanamine;hydrobromide |
| InChI | InChI=1S/C15H15ClN2O2.BrH/c16-14-7-5-12(6-8-14)9-10-17-11-13-3-1-2-4-15(13)18(19)20;/h1-8,17H,9-11H2;1H |
| InChI Key | WAKJWZAIKUJEJM-UHFFFAOYSA-N |
| MDL Number | MFCD13186437 |
| Molecular Formula | C15H16BrClN2O2 |
| Molecular Weight | 371.6567 |
| SMILES | [N+](=O)([O-])C1=CC=CC=C1CNCCC1C=CC(Cl)=CC=1.Br |
| Synonyms | [2-(4-chlorophenyl)ethyl](2-nitrobenzyl)amine hydrobromide,
1609396-38-4,
ZX-CM015796,
MFCD13186437,
418780-23-1,
|
| Complexity | 301 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 370.008g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 371.659g/mol |
| Monoisotopic Mass | 370.008g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 57.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number